3-[1-[6-[(1R)-1-aminopropyl]-3-pyridinyl]pyrrolidin-2-yl]propan-1-ol

C15H25N3O — CID 103937288

IUPAC3-[1-[6-[(1R)-1-aminopropyl]-3-pyridinyl]pyrrolidin-2-yl]propan-1-ol
SMILESCC[C@@H](N)c1ccc(N2CCCC2CCCO)cn1
InChIInChI=1S/C15H25N3O/c1-2-14(16)15-8-7-13(11-17-15)18-9-3-5-12(18)6-4-10-19/h7-8,11-12,14,19H,2-6,9-10,16H2,1H3/t12?,14-/m1/s1
InChIKeyCHHFAWSPBKSIOB-TYZXPVIJSA-N
MW263.38 g/mol
LogP2.23
Rot. Bonds6

About 3-[1-[6-[(1R)-1-aminopropyl]-3-pyridinyl]pyrrolidin-2-yl]propan-1-ol

3-[1-[6-[(1R)-1-aminopropyl]-3-pyridinyl]pyrrolidin-2-yl]propan-1-ol (PubChem CID 103937288) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 3-[1-[6-[(1R)-1-aminopropyl]-3-pyridinyl]pyrrolidin-2-yl]propan-1-ol.

Molecular Properties

Compound Name3-[1-[6-[(1R)-1-aminopropyl]-3-pyridinyl]pyrrolidin-2-yl]propan-1-ol
PubChem CID103937288
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name3-[1-[6-[(1R)-1-aminopropyl]-3-pyridinyl]pyrrolidin-2-yl]propan-1-ol
SMILESCC[C@@H](N)c1ccc(N2CCCC2CCCO)cn1
InChIInChI=1S/C15H25N3O/c1-2-14(16)15-8-7-13(11-17-15)18-9-3-5-12(18)6-4-10-19/h7-8,11-12,14,19H,2-6,9-10,16H2,1H3/t12?,14-/m1/s1
InChIKeyCHHFAWSPBKSIOB-TYZXPVIJSA-N
XLogP2.23
TPSA62.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-[1-[6-[(1R)-1-aminoethyl]-3-pyridinyl]pyrrolidin-2-yl]propan-1-ol
CID 83122786
3-[1-[6-[1-(methylamino)ethyl]-3-pyridinyl]pyrrolidin-2-yl]propan-1-ol
CID 83122531
(1R)-1-[5-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)-2-pyridinyl]propan-1-amine
CID 103937439
1-[5-[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-2-pyridinyl]propan-1-amine
CID 102726759
(1S)-1-[5-(2,3,3a,4,5,6,7,7a-octahydroindol-1-yl)-2-pyridinyl]propan-1-amine
CID 103937555
(1R)-1-[5-(2-methylazepan-1-yl)-2-pyridinyl]propan-1-amine
CID 103937411
[1-[6-[(1R)-1-aminopropyl]-3-pyridinyl]piperidin-3-yl]methanol
CID 103937018
[1-[6-[(1R)-1-aminoethyl]-3-pyridinyl]piperidin-2-yl]methanol
CID 83122235
1-[1-[6-(1-aminopropyl)-3-pyridinyl]piperidin-4-yl]ethanol
CID 106836278
(1S)-1-[5-(2-ethylpyrrolidin-1-yl)-2-pyridinyl]ethanol
CID 83132296
1-[6-[(1R)-1-aminopropyl]-3-pyridinyl]piperidin-4-ol
CID 103936925
3-[1-[4-(1-hydroxyethyl)phenyl]pyrrolidin-2-yl]propan-1-ol
CID 62467233

Frequently Asked Questions

What is the IUPAC name of 3-[1-[6-[(1R)-1-aminopropyl]-3-pyridinyl]pyrrolidin-2-yl]propan-1-ol?
The IUPAC name of 3-[1-[6-[(1R)-1-aminopropyl]-3-pyridinyl]pyrrolidin-2-yl]propan-1-ol (CID 103937288) is 3-[1-[6-[(1R)-1-aminopropyl]-3-pyridinyl]pyrrolidin-2-yl]propan-1-ol.
What is the SMILES notation for 3-[1-[6-[(1R)-1-aminopropyl]-3-pyridinyl]pyrrolidin-2-yl]propan-1-ol?
The canonical SMILES for 3-[1-[6-[(1R)-1-aminopropyl]-3-pyridinyl]pyrrolidin-2-yl]propan-1-ol is CC[C@@H](N)c1ccc(N2CCCC2CCCO)cn1.
What is the InChIKey of 3-[1-[6-[(1R)-1-aminopropyl]-3-pyridinyl]pyrrolidin-2-yl]propan-1-ol?
The InChIKey is CHHFAWSPBKSIOB-TYZXPVIJSA-N. The full InChI is InChI=1S/C15H25N3O/c1-2-14(16)15-8-7-13(11-17-15)18-9-3-5-12(18)6-4-10-19/h7-8,11-12,14,19H,2-6,9-10,16H2,1H3/t12?,14-/m1/s1.
What are the key properties of 3-[1-[6-[(1R)-1-aminopropyl]-3-pyridinyl]pyrrolidin-2-yl]propan-1-ol?
3-[1-[6-[(1R)-1-aminopropyl]-3-pyridinyl]pyrrolidin-2-yl]propan-1-ol has a molecular weight of 263.38 g/mol, XLogP of 2.23, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-[6-[(1R)-1-aminopropyl]-3-pyridinyl]pyrrolidin-2-yl]propan-1-ol is sourced from PubChem (CID 103937288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).